ChemSpider 2D Image | prosopinine | C16H33NO3

prosopinine

  • Molecular FormulaC16H33NO3
  • Average mass287.438 Da
  • Monoisotopic mass287.246033 Da
  • ChemSpider ID24823233

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(2R,3R,6R)-6-(8-Hydroxydecyl)-2-(hydroxymethyl)-3-piperidinol [German] [ACD/IUPAC Name]
(2R,3R,6R)-6-(8-Hydroxydecyl)-2-(hydroxymethyl)-3-piperidinol [ACD/IUPAC Name]
(2R,3R,6R)-6-(8-Hydroxydécyl)-2-(hydroxyméthyl)-3-pipéridinol [French] [ACD/IUPAC Name]
2-Piperidineoctanol, α-ethyl-5-hydroxy-6-(hydroxymethyl)-, (2R,5R,6R)- [ACD/Index Name]
prosopinine
(2R,3R,6R)-6-(8-hydroxydecyl)-2-(hydroxymethyl)piperidin-3-ol
6R-(8-hydroxydecyl)-2R-(hydroxymethyl)-piperidin-3R-ol

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point: 448.1±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 81.5±6.0 kJ/mol
Flash Point: 108.4±15.1 °C
Index of Refraction: 1.487
Molar Refractivity: 82.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 4
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 1.76
ACD/LogD (pH 5.5): -1.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.21
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.49
Polar Surface Area: 73 Å2
Polarizability: 32.6±0.5 10-24cm3
Surface Tension: 39.8±3.0 dyne/cm
Molar Volume: 285.6±3.0 cm3

Click to predict properties on the Chemicalize site


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